CAS
898790-14-2 Purity
96%
898790-14-2 Purity
96%
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2-Chloro-4-fluorophenyl cyclopropyl ketone
CAS
898790-18-6
Catalog Number
ACM898790186
Category
Other Products
Molecular Weight
198.62
Molecular Formula
C10H8ClFO
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Specification
Synonyms
2-CHLORO-4-FLUOROPHENYL CYCLOPROPYL KETONE
IUPAC Name
(2-chloro-4-fluorophenyl)-cyclopropylmethanone
Canonical SMILES
C1CC1C(=O)C2=C(C=C(C=C2)F)Cl
InChI Key
QDTSLTYNCQDYNR-UHFFFAOYSA-N
Boiling Point
253.6ºC at 760 mmHg
Flash Point
107.2ºC
Density
1.356g/cm³
Exact Mass
198.02500
H-Bond Acceptor
2
H-Bond Donor
0
What is the molecular formula of 2-Chloro-4-fluorophenyl cyclopropyl ketone?
The molecular formula of 2-Chloro-4-fluorophenyl cyclopropyl ketone is C10H8ClFO.
When was 2-Chloro-4-fluorophenyl cyclopropyl ketone created and modified?
It was created on 2008-02-29 and modified on 2023-12-30.
What is the IUPAC name of 2-Chloro-4-fluorophenyl cyclopropyl ketone?
The IUPAC name is (2-chloro-4-fluorophenyl)-cyclopropylmethanone.
What is the InChI of 2-Chloro-4-fluorophenyl cyclopropyl ketone?
The InChI is InChI=1S/C10H8ClFO/c11-9-5-7(12)3-4-8(9)10(13)6-1-2-6/h3-6H,1-2H2.
What is the InChIKey of 2-Chloro-4-fluorophenyl cyclopropyl ketone?
The InChIKey is QDTSLTYNCQDYNR-UHFFFAOYSA-N.
What is the Canonical SMILES of 2-Chloro-4-fluorophenyl cyclopropyl ketone?
The Canonical SMILES is C1CC1C(=O)C2=C(C=C(C=C2)F)Cl.
What is the CAS number of 2-Chloro-4-fluorophenyl cyclopropyl ketone?
The CAS number is 898790-18-6.
What is the XLogP3-AA value of 2-Chloro-4-fluorophenyl cyclopropyl ketone?
The XLogP3-AA value is 2.8.
How many hydrogen bond acceptor counts are there in 2-Chloro-4-fluorophenyl cyclopropyl ketone?
There are 2 hydrogen bond acceptor counts.
Is 2-Chloro-4-fluorophenyl cyclopropyl ketone a canonicalized compound?
Yes, it is a canonicalized compound.
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